3,4,5-Tris(11-methacryloylundecyl-1-oxybenzoyloxy)benzoic acid | 261168-18-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 3,4,5-Tris(11-methacryloylundecyl-1-oxybenzoyloxy)benzoic acid
• 英文别名: 3,4,5-Tris[[4-[11-(2-methylprop-2-enoyloxy)undecoxy]phenyl]methoxy]benzoic acid；3,4,5-tris[[4-[11-(2-methylprop-2-enoyloxy)undecoxy]phenyl]methoxy]benzoic acid
• CAS: 261168-18-7
• 化学式: C₇₃H₁₀₂O₁₄
• 分子量: 1203.6
• InChiKey: CSIGFVUDGKQXOI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  20.7
• 重原子数：
  87
• 可旋转键数：
  55
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.53
• 拓扑面积：
  172
• 氢给体数：
  1
• 氢受体数：
  14

反应信息

• 作为反应物：
  描述：

  4`-(羟甲基)苯并-15-冠-5 、 3,4,5-Tris(11-methacryloylundecyl-1-oxybenzoyloxy)benzoic acid 在 N,N'-二环己基碳二亚胺 、 DPTS 作用下， 以 二氯甲烷 为溶剂， 反应 12.0h， 以90%的产率得到2-Methyl-(1,4,7,10,13-pentaoxacyclopentadecane)-3,4,5-tris[4-(11-methacryloylundecyl-1-oxy)benzoyloxy]benzoate
  参考文献：
  名称：

  Synthesis and Characterization of Tris-Methacrylated 3,4,5-Tris[(alkoxy)benzyloxy]benzoate Derivatives

  摘要：

  The synthesis of liquid crystalline 3,4,5-tris(11-methacryloylundecyl-1-oxybenzyloxy)benzoic acid, 2-methyl-(1,4,7,10,13-pentaoxacyclopentadecane)-3,4,5-tris[4-(11-methacryloylundecyl-1-oxy)benzyloxy] benzoate and its 1:1 complex with sodium triflate is described. The observed mesophases were identified, by polarized optical microscopy and contact preparation techniques, to be of hexagonal columnar disordered structure. The amphiphiles form lyotropic columnar phases in concentrated methacrylate solvents, while at low solute contents supramolecular organogels emerge.

  DOI：

  10.1002/1521-3765(20000602)6:11<2016::aid-chem2016>3.0.co;2-s
• 作为产物：
  描述：

  4-十一碳-10-烯氧基苯甲酸甲酯 在 4-二甲氨基吡啶 、 lithium aluminium tetrahydride 、 9-borabicyclo[3.3.1]nonane dimer 、 氯化亚砜 、 2,6-二叔丁基苯酚 、 potassium carbonate 、 三乙胺 、 N,N-二甲基甲酰胺 作用下， 以 四氢呋喃 、 二氯甲烷 、 N,N-二甲基甲酰胺 为溶剂， 反应 68.0h， 生成 3,4,5-Tris(11-methacryloylundecyl-1-oxybenzoyloxy)benzoic acid
  参考文献：
  名称：

  Synthesis and Characterization of Tris-Methacrylated 3,4,5-Tris[(alkoxy)benzyloxy]benzoate Derivatives

  摘要：

  The synthesis of liquid crystalline 3,4,5-tris(11-methacryloylundecyl-1-oxybenzyloxy)benzoic acid, 2-methyl-(1,4,7,10,13-pentaoxacyclopentadecane)-3,4,5-tris[4-(11-methacryloylundecyl-1-oxy)benzyloxy] benzoate and its 1:1 complex with sodium triflate is described. The observed mesophases were identified, by polarized optical microscopy and contact preparation techniques, to be of hexagonal columnar disordered structure. The amphiphiles form lyotropic columnar phases in concentrated methacrylate solvents, while at low solute contents supramolecular organogels emerge.

  DOI：

  10.1002/1521-3765(20000602)6:11<2016::aid-chem2016>3.0.co;2-s

文献信息

• Synthesis and Characterization of Tris-Methacrylated 3,4,5-Tris[(alkoxy)benzyloxy]benzoate Derivatives
  作者：Uwe Beginn、Gabriela Zipp、Martin Möller

  DOI：10.1002/1521-3765(20000602)6:11<2016::aid-chem2016>3.0.co;2-s

  日期：2000.6.2

  The synthesis of liquid crystalline 3,4,5-tris(11-methacryloylundecyl-1-oxybenzyloxy)benzoic acid, 2-methyl-(1,4,7,10,13-pentaoxacyclopentadecane)-3,4,5-tris[4-(11-methacryloylundecyl-1-oxy)benzyloxy] benzoate and its 1:1 complex with sodium triflate is described. The observed mesophases were identified, by polarized optical microscopy and contact preparation techniques, to be of hexagonal columnar disordered structure. The amphiphiles form lyotropic columnar phases in concentrated methacrylate solvents, while at low solute contents supramolecular organogels emerge.